⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL3277845 | 0.91 | — | — | |
| SCHEMBL28459709 | 0.91 | — | — | |
| SCHEMBL320881 | 0.91 | — | — | |
| SCHEMBL16110925 | 0.83 | — | — | |
| SCHEMBL28964259 | 0.83 | — | — | |
| SCHEMBL4451136 | 0.83 | — | — | |
| SCHEMBL1255672 | 0.83 | — | — | |
| SCHEMBL1255655 | 0.83 | — | — | |
| SCHEMBL4894288 | 0.83 | — | — | |
| SCHEMBL1221937 | 0.82 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080035492-A1 | Oxygen Transport Structure | HILLIARD DONALD B | 2008-02-14 | — | — | US | disclosed |
| WO-2006076136-A2 | OXYGEN TRANSPORT STRUCTURE | HILLIARD DONALD B (US) | 2006-07-20 | — | — | WO | disclosed |